5-Fluoroorotic acid
Properties
- Molecular formula
- C5H3FN2O4
- Molar mass
- 174.09 g/mol
- Exact mass
- 174.0077 Da
- Melting point
- 255 °C (decomposes)
- logP
- -0.27Crippen estimate
- Polar surface area
- 103.5 Ų
- H-bond donors / acceptors
- 3 / 5
- Rotatable bonds
- 1
Hazards
Warning
- H302 Harmful if swallowed100% of notifiers
- H315 Causes skin irritation95.7% of notifiers
- H319 Causes serious eye irritation95.7% of notifiers
- H335 May cause respiratory irritation95.7% of notifiers
Aggregated from 47 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
703-95-7SMILES
O=C(O)c1nc(O)nc(O)c1FInChIKey
SEHFUALWMUWDKS-UHFFFAOYSA-NInChI
InChI=1S/C5H3FN2O4/c6-1-2(4(10)11)7-5(12)8-3(1)9/h(H,10,11)(H2,7,8,9,12)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
10 names
- 5-Fluoro-2,6-dihydroxypyrimidine-4-carboxylic acid
- 4-Pyrimidinecarboxylic acid, 5-fluoro-1,2,3,6-tetrahydro-2,6-dioxo-
- Orotic acid, 5-fluoro-
- 5-Fluoro-1,2,3,6-tetrahydro-2,6-dioxo-4-pyrimidinecarboxylic acid
- Fluoroorotic acid
- ENT 26398
- NSC 31712
- WR 152520
- 5-Fluoroorotate
- NSC 143130
Work with 5-Fluoroorotic acid
Similar compounds
5-Amino-1,2,3,6-tetrahydro-2,6-dioxo-4-pyrimidinecarboxylic acid7164-43-460 % similar
1,2,3,4-Tetrahydro-2,4-dioxo-5-pyrimidinecarboxylic acid23945-44-045 % similar
2,3,5,6-Tetrafluoro-1,4-benzenedicarboxylic acid652-36-841 % similar
Pentafluorobenzoic acid602-94-839 % similar
Tetrafluorophthalic acid652-03-939 % similar
Tetrafluoro-4-hydroxybenzoic acid652-34-639 % similar
Orotic acid65-86-138 % similar
Tetrafluoroisophthalic acid1551-39-938 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.